Information card for entry 7030828

Structure parameters

• Formula: C44 H65 N6 Nd Si4
• Calculated formula: C44 H65 N6 Nd Si4
• SMILES: [Nd]123456([n]7n(c(cc7C)C)C(n7[n]1c(cc7C)C)C([c]14[cH]2[cH]3[cH]6[cH]51)(c1ccccc1)c1ccccc1)(N([SiH](C)C)[SiH](C)C)N([SiH](C)C)[SiH](C)C.c1(ccccc1)C
• Title of publication: Synthesis and structural characterization of amido scorpionate rare earth metals complexes.
• Authors of publication: Márquez-Segovia, Isabel; Lara-Sánchez, Agustín; Otero, Antonio; Fernández-Baeza, Juan; Castro-Osma, José Antonio; Sánchez-Barba, Luis F; Rodríguez, Ana M
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 25
• Pages of publication: 9586 - 9595
• a: 17.107 ± 0.007 Å
• b: 17.353 ± 0.003 Å
• c: 16.089 ± 0.006 Å
• α: 90°
• β: 98.231 ± 0.013°
• γ: 90°
• Cell volume: 4727 ± 3 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1492
• Residual factor for significantly intense reflections: 0.0629
• Weighted residual factors for significantly intense reflections: 0.1109
• Weighted residual factors for all reflections included in the refinement: 0.1398
• Goodness-of-fit parameter for all reflections included in the refinement: 0.843
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No